Reaction smiles
cccc(c)O.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>ccc(CC=C(C)C)c(c)O.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#8]-[#6](:[#6]:[#6]:[#6]):[#6].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#8]-[#6](:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:[#6]):[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
3
Size
9
Atom
3
ID
PTDBDEP00230
Smiles
cc1ccccc1OC
Reaction smiles
cc1ccccc1OC.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc1cccc(CC=C(C)C)c1OC.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]:[#6]:[#6]:1:[#6].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:[#6]:[#6]:[#6]:1:[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
4
Size
12
Atom
3
ID
PTDBDEP00231
Smiles
COc1cccc2[nH]cc(C)c12
Reaction smiles
COc1cccc2[nH]cc(C)c12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>COc1c(CC=C(C)C)ccc2[nH]cc(C)c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]):[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]):[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
5
Size
13
Atom
3
ID
PTDBDEP00232
Smiles
CCc1c[nH]c2cccc(OC)c12
Reaction smiles
CCc1c[nH]c2cccc(OC)c12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CCc1c[nH]c2ccc(CC=C(C)C)c(OC)c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]-[#6H]):[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]-[#6H]):[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]